Base information

Cat. No.
CAS No.64158-84-5
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C48H69N13O11S2
Molecular Weight 1068.27
Exact Mass 1067.47
XLogP3 2.9923
Mr 299.668
PSA 442.92
Sequence -
Atom number 143
Bond number 146
Ring number 4
Rotor number 21
Residues number 0
Canonical smiles NC(=N)NCCC[C@H](C(=O)NCC(=O)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CSSC(C)(C)CC(=O)N[C@@H](Cc2ccc(cc2)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC(=O)N)C(C)C)Cc1ccccc1

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